5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one

C20H16N4O — CID 58589534

IUPAC5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one
SMILESNc1cncc2c1c(=O)cc(Nc1ccccc1)n2-c1ccccc1
InChIInChI=1S/C20H16N4O/c21-16-12-22-13-17-20(16)18(25)11-19(23-14-7-3-1-4-8-14)24(17)15-9-5-2-6-10-15/h1-13,23H,21H2
InChIKeyHEJWVMVKJOEZRO-UHFFFAOYSA-N
MW328.38 g/mol
LogP3.71
Rot. Bonds3

About 5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one

5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one (PubChem CID 58589534) has the molecular formula C20H16N4O and a molecular weight of 328.38 g/mol. Its IUPAC name is 5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one.

Molecular Properties

Compound Name5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one
PubChem CID58589534
Molecular FormulaC20H16N4O
Molecular Weight328.38 g/mol
Exact Mass328.13
IUPAC Name5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one
SMILESNc1cncc2c1c(=O)cc(Nc1ccccc1)n2-c1ccccc1
InChIInChI=1S/C20H16N4O/c21-16-12-22-13-17-20(16)18(25)11-19(23-14-7-3-1-4-8-14)24(17)15-9-5-2-6-10-15/h1-13,23H,21H2
InChIKeyHEJWVMVKJOEZRO-UHFFFAOYSA-N
XLogP3.71
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.38
LogP ≤ 53.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2,8-dianilino-1-phenyl-1,6-naphthyridin-4-one
CID 20790469
2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-7-carboxamide
CID 10155193
2-anilino-4-oxo-1-phenyl-1,6-naphthyridine-8-carboxylic acid
CID 10291839
2-anilino-1-(3-methoxyphenyl)-1,7-naphthyridin-4-one
CID 58589526
2-anilino-5-(anilinomethyl)-7-methyl-1-phenyl-1,6-naphthyridin-4-one
CID 20790544
7-anilino-2-methyl-5-oxo-8-phenyl-1,8-naphthyridine-4-carboxylic acid
CID 20791091
2-anilino-8-[(2-methylpropan-2-yl)oxy]-1-phenyl-1,6-naphthyridin-4-one
CID 20790507
(E)-3-(2-anilino-7-methyl-4-oxo-1-phenyl-1,6-naphthyridin-5-yl)prop-2-enoic acid
CID 20790965
2-anilino-7-methyl-5-(4-methylpiperazin-1-yl)-1-phenyl-1,6-naphthyridin-4-one
CID 20790833
2-(2-bicyclo[4.1.0]hept-2-enylamino)-5-methyl-1-phenyl-1,7-naphthyridin-4-one;molecular hydrogen
CID 142837631
2-anilino-1-phenyl-1,8-naphthyridin-4-one
CID 141067621
2-anilino-8-(phenoxymethyl)-1-phenyl-1,6-naphthyridin-4-one
CID 20790921

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one?
The IUPAC name of 5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one (CID 58589534) is 5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one.
What is the SMILES notation for 5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one?
The canonical SMILES for 5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one is Nc1cncc2c1c(=O)cc(Nc1ccccc1)n2-c1ccccc1.
What is the InChIKey of 5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one?
The InChIKey is HEJWVMVKJOEZRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O/c21-16-12-22-13-17-20(16)18(25)11-19(23-14-7-3-1-4-8-14)24(17)15-9-5-2-6-10-15/h1-13,23H,21H2.
What are the key properties of 5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one?
5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one has a molecular weight of 328.38 g/mol, XLogP of 3.71, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-anilino-1-phenyl-1,7-naphthyridin-4-one is sourced from PubChem (CID 58589534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).